5-bromanyl-3-methyl-2-(propan-2-ylamino)benzoic acid

Systemtic Name: 5-bromanyl-3-methyl-2-(propan-2-ylamino)benzoic acid Openeye Name: 5-bromo-2-(isopropylamino)-3-methyl-benzoic acid CAS Name: 5-bromo-3-methyl-2-(propan-2-ylamino)benzoic acid IUPAC Name: 5-bromo-3-methyl-2-(propan-2-ylamino)benzoic acid Traditional Name: 5-bromo-2-(isopropylamino)-3-methyl-benzoic acid Formula: C11H14BrNO2 MolecularWeight: 272.13836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)O)NC(C)C

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)O)NC(C)C

InChI

InChI=1S/C11H14BrNO2/c1-6(2)13-10-7(3)4-8(12)5-9(10)11(14)15/h4-6,13H,1-3H3,(H,14,15)